Vitas-M small molecule compound
2,3-dimethylphenyl 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)benzoate
Catalog ID
STK253532
SMILES O=C(c1ccc(cc1)N1C(=O)C2C(C1=O)CCCC2)Oc1cccc(c1C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H23NO4 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO4/c1-14-6-5-9-20(15(14)2)28-23(27)16-10-12-17(13-11-16)24-21(25)18-7-3-4-8-19(18)22(24)26/h5-6,9-13,18-19H,3-4,7-8H2,1-2H3InChIKey
JRDOBPLYFKNCEU-UHFFFAOYSA-NSynonyms
(23dimethylphenyl)4(13dioxo3a45677ahexahydroisoindol2yl)benzoate
23dimethylphenyl4(13dioxooctahydro2Hisoindol2yl)benzoate
CC1=C(C(=CC=C1)OC(=O)C2=CC=C(C=C2)N3C(=O)C4CCCCC4C3=O)C
InChI=1SC23H23NO4c11465920(15(14)2)2823(27)16101217(131116)2421(25)18734819(18)22(24)26h569131819H3478H212H3
MFCD03146280
ZINC000013846682
ZINC000100839004
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